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canSAR789873
FEATURES
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NAMES
    SMILES
    COCC[C@H]1CC2CN3CCc4c([nH]c5ccccc45)[C@](C(=O)OCCN(C)C)(C2)[C@H]13
    InChI
    InChI=1S/C25H35N3O3/c1-27(2)11-13-31-24(29)25-15-17-14-18(9-12-30-3)23(25)28(16-17)10-8-20-19-6-4-5-7-21(19)26-22(20)25/h4-7,17-18,23,26H,8-16H2,1-3H3/t17?,18-,23-,25+/m0/s1
    MOLECULAR FORMULA
    C25H35N3O3
    CROSS REFERENCES
    789873 logo

    canSAR789873

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 425.27
    AlogP 2.81
    HBond donors 1
    HBond acceptors 6
    Atoms 66
    Contains toxicophore No
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR789873.